Summary

IMPPAT Phytochemical identifier: IMPHY004080

Phytochemical name: Corypalline

Synonymous chemical names:
corypalline

External chemical identifiers:
CID:280225, ChEMBL:CHEMBL593001, ZINC:ZINC000000338406, SureChEMBL:SCHEMBL20683185

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Chemical structure information

SMILES:
COc1cc2CCN(Cc2cc1O)C

InChI:
InChI=1S/C11H15NO2/c1-12-4-3-8-6-11(14-2)10(13)5-9(8)7-12/h5-6,13H,3-4,7H2,1-2H3

InChIKey:
FELOSQQXIHRUSH-UHFFFAOYSA-N

DeepSMILES:
COcccCCNCc6cc%10O)))))C

Functional groups:
CN(C)C, cO, cOC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccc2c(c1)CCNC2

Scaffold Graph/Node level:
C1CCC2CNCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Tetrahydroisoquinolines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Tyrosine alkaloids

NP Classifier Class: Amarylidaceae alkaloids

NP-Likeness score: 0.519

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Chemical structure download